N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Openeye Name: N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-3,5-dimethyl-isoxazole-4-carboxamide CAS Name: N-[[2-(diethylamino)-3-pyridin-1-iumyl]methyl]-3,5-dimethyl-4-isoxazolecarboxamide IUPAC Name: N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Traditional Name: N-[[2-(diethylamino)pyridin-1-ium-3-yl]methyl]-3,5-dimethyl-isoxazole-4-carboxamide Formula: C16H23N4O2+ MolecularWeight: 303.37942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=CC=[NH+]1)CNC(=O)C2=C(ON=C2C)C

Isomeric SMILES

CCN(CC)C1=C(C=CC=[NH+]1)CNC(=O)C2=C(ON=C2C)C

InChI

InChI=1S/C16H22N4O2/c1-5-20(6-2)15-13(8-7-9-17-15)10-18-16(21)14-11(3)19-22-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,18,21)/p+1